A.H. Reshak

Research interests

Publications

• Coupling ferroelectric polarization and anisotropic charge migration for enhanced CO2 photoreduction

  Applied Catalysis B: Environmental · 2020 · 10.1016/j.apcatb.2020.119709

• Ferroelectric polarization promoted bulk charge separation for highly efficient CO2 photoreduction of SrBi4Ti4O15

  Nano Energy · 2018 · 10.1016/j.nanoen.2018.12.016

• Spin-polarized Second Harmonic Generation from the Antiferromagnetic CaCoSO Single Crystal

  Scientific Reports · 2017 · 10.1038/srep46415

• Macroscopic Polarization Enhancement Promoting Photo‐ and Piezoelectric‐Induced Charge Separation and Molecular Oxygen Activation

  Angewandte Chemie International Edition · 2017 · https://doi.org/10.1002/anie.201706549

• Exploration of the Electronic Structure of Monoclinic α-Eu 2 (MoO 4 ) 3 : DFT-Based Study and X-ray Photoelectron Spectroscopy

  The Journal of Physical Chemistry C · 2016 · 10.1021/acs.jpcc.6b01489

• Chlorine intercalation in graphitic carbon nitride for efficient photocatalysis

  Applied Catalysis B: Environmental · 2016 · https://doi.org/10.1016/j.apcatb.2016.10.002

• Structural, mechanical and electronic properties of sodium based fluoroperovskites NaXF3 (X=Mg, Zn) from first-principle calculations

  Materials Science in Semiconductor Processing · 2015 · 10.1016/j.mssp.2015.01.040

• Materials for Enhanced Dye-sensitized Solar Cell Performance: Electrochemical Application

  International Journal of Electrochemical Science · 2015 · 10.1016/s1452-3981(23)06503-3

• Fe 2 MnSi x Ge 1−x : influence thermoelectric properties of varying the germanium content

  RSC Advances · 2014 · 10.1039/c4ra02669a

• Thermoelectric properties for AA- and AB-stacking of a carbon nitride polymorph (C 3 N 4 )

  RSC Advances · 2014 · 10.1039/c4ra13342k

• Structural, Electronic and Optical Properties in Earth- Abundant Photovoltaic Absorber of Cu2ZnSnS4 and Cu2ZnSnSe4 from DFT calculations

  International Journal of Electrochemical Science · 2014 · 10.1016/s1452-3981(23)07770-2

• Ab initio study of TaON, an active photocatalyst under visible light irradiation

  Physical Chemistry Chemical Physics · 2014 · 10.1039/c4cp00285g

• Linear, non-linear optical susceptibilities and the hyperpolarizability of the mixed crystals Ag0.5Pb1.75Ge(S1−xSex)4: experiment and theory

  Physical Chemistry Chemical Physics · 2013 · 10.1039/c3cp53431f

• Photoelectrical properties and the electronic structure of Tl1−xIn1−xSnxSe2 (x = 0, 0.1, 0.2, 0.25) single crystalline alloys

  Physical Chemistry Chemical Physics · 2013 · 10.1039/c3cp50836f

• DFT calculation for elastic constants of orthorhombic structure within WIEN2K code: A new package (ortho-elastic)

  Journal of Alloys and Compounds · 2012 · 10.1016/j.jallcom.2012.07.107

• Dispersion of linear and nonlinear optical susceptibilities and the hyperpolarizability of 3-methyl-4-phenyl-5-(2-pyridyl)-1,2,4-triazole

  Physical Chemistry Chemical Physics · 2010 · 10.1039/c0cp01601b

• Investigation of the Linear and Nonlinear Optical Susceptibilities of KTiOPO4 Single Crystals: Theory and Experiment

  The Journal of Physical Chemistry B · 2010 · 10.1021/jp1072878

• Ab-initio calculations of Co-based diluted magnetic semiconductors Cd1−xCoxX (X=S, Se, Te)

  Journal of Magnetism and Magnetic Materials · 2010 · 10.1016/j.jmmm.2010.06.001

• Theoretical study of mechanical, electronic, chemical bonding and optical properties of Ti2SnC, Zr2SnC, Hf2SnC and Nb2SnC

  Computational Materials Science · 2009 · 10.1016/j.commatsci.2009.09.015

• FP-APW+lo calculations of the elastic properties in zinc-blende III-P compounds under pressure effects

  Computational Materials Science · 2009 · 10.1016/j.commatsci.2008.11.013

• Thickness dependence of structural, electrical and optical behaviour of undoped ZnO thin films

  Physica B Condensed Matter · 2008 · 10.1016/j.physb.2008.04.045

• Ab‐initio investigation of structural, electronic and optical properties for three phases of ZnO compound

  physica status solidi (b) · 2007 · 10.1002/pssb.200642471

• Elastic, electronic and optical properties of ZnS, ZnSe and ZnTe under pressure

  Computational Materials Science · 2006 · https://doi.org/10.1016/j.commatsci.2006.01.013

• Ab initio study of structural, electronic, elastic and high pressure properties of barium chalcogenides

  Computational Materials Science · 2006 · 10.1016/j.commatsci.2006.03.001

• Electronic and optical properties of the 1 T phases of TiS 2 , TiSe 2 , and TiTe 2

  Physical review. B, Condensed matter · 2003 · 10.1103/physrevb.68.245113

Current projects

No projects listed.